Theoretical study on novel quantum yields of dithienylethenes cyclization reactions in crystals

Yukako Asano, Akinori Murakami, Takao Kobayashib, Seiya Kobatake, Masahiro Irie, Satoshi Yabushita, Shinichiro Nakamura

研究成果: Article査読

23 被引用数 (Scopus)

抄録

Novel quantum yields (QYs) of photochromic cyclization reactions are studied for 1,2-bis (2-methyl-5-phenyl-3-thienyl) perfluorocyclopentene (1) and 1,2-bis (2-methyl-1-benzothiophen-3-yl) perfluorocyclopentene (2). The difference of the QYs in crystals and hexane solution for the molecules 1 and 2 is explained by their initial geometries, the relaxation from the Franck-Condon states, the shapes of the potential energy surfaces of the ground state, and the geometry change by the large amplitude motions.

本文言語English
ページ(範囲)227-234
ページ数8
ジャーナルJournal of Molecular Structure: THEOCHEM
625
1-3
DOI
出版ステータスPublished - 2003 5月 5
外部発表はい

ASJC Scopus subject areas

  • 生化学
  • 凝縮系物理学
  • 物理化学および理論化学

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